Inorganic Solid Phases

Li0.67H0.33IO3 (H0.33Li0.67[IO3]) Crystal Structure

General Information

  • Phase Label(s): H0.33Li0.67[IO3]
  • Structure Class(es):
  • Classification by Properties: piezoelectric
  • Mineral Name(s):
  • Pearson Symbol: hP10
  • Space Group: 173
  • Phase Prototype: Li[IO3]
  • Measurement Detail(s): Guinier film (determination of cell parameters), diffractometer; Enraf-Nonius CAD4 (determination of structural parameters), X-rays, Cu Kα; λ = 0.15418 nm (determination of cell parameters), X-rays, Mo Kα; λ = 0.071069 nm (determination of structural parameters)
  • Phase Class(es):
  • Compound Class(es): iodate
  • Interpretation Detail(s): complete structure determined; composition dependence studied, Rietveld refinement; 265 reflections, R = 0.032; wR = 0.044
  • Sample Detail(s): powder (determination of cell parameters), single crystal (determination of structural parameters)

Substance Summary

  • Standard Formula: H0.33Li0.67[IO3]
  • Alphabetic Formula: H0.33[IO3]Li0.67
  • Published Formula: Li0.67H0.33IO3
  • Refined Formula: H0.33ILi0.67O3
  • Wyckoff Sequence: 173,cba
  • Z Formula Units: 2
  • Density: ρ = 4.52 Mg·m−3

Crystallographic Data

Cell Parameters

Published Data
Standardized Data
Unit Cell
Niggli-Reduced Cell
Space Group
a
b
c
α
β
γ
a/b
b/c
c/a
V

Atom Coordinates

Standardized

Site
Element
Wyckoff Symbol
Symmetry
X
Y
Z
Occupation
Co-ord. No.
Atomic Env.

Published

Site
Element
Wyckoff Symbol
Symmetry
X
Y
Z
Occupation

Displacement Parameters

Isotropic

Site
Published
B [nm2]
Type
Computed
Beq [nm2]

Anisotropic

Site
β11 [nm2]
β22 [nm2]
β33 [nm2]
β12 [nm2]
β13 [nm2]
β23 [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_0552210

  • Copyright

    ©Springer & Material Phases Data System (MPDS), Switzerland & National Institute for Materials Science (NIMS), Japan, 2016

  • Chief Editor

    Pierre Villars, Material Phases Data System (MPDS), CH-6354 Vitznau, Switzerland

    villars.mpds@bluewin.ch

  • Credits

    SpringerMaterials Release 2016.

    Data generated pre-2002: © Springer & MPDS & NIMS; post-2001: © Springer & MPDS

    All Rights Reserved. Version 2016.10.

    Project Coordinator: Shuichi Iwata

    Section-Editor: Karin Cenzual (Crystal Structures)

  • Cite this content

    Citation copied